1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide

C19H18FN3O4 — CID 142685092

IUPAC1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide
SMILESCC(O)CNC(=O)c1c(O)c2ncccc2n(Cc2ccc(F)cc2)c1=O
InChIInChI=1S/C19H18FN3O4/c1-11(24)9-22-18(26)15-17(25)16-14(3-2-8-21-16)23(19(15)27)10-12-4-6-13(20)7-5-12/h2-8,11,24-25H,9-10H2,1H3,(H,22,26)
InChIKeyFKVLKOGALOZOGM-UHFFFAOYSA-N
MW371.37 g/mol
LogP1.40
Rot. Bonds5

About 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide

1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide (PubChem CID 142685092) has the molecular formula C19H18FN3O4 and a molecular weight of 371.37 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide
PubChem CID142685092
Molecular FormulaC19H18FN3O4
Molecular Weight371.37 g/mol
Exact Mass371.13
IUPAC Name1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide
SMILESCC(O)CNC(=O)c1c(O)c2ncccc2n(Cc2ccc(F)cc2)c1=O
InChIInChI=1S/C19H18FN3O4/c1-11(24)9-22-18(26)15-17(25)16-14(3-2-8-21-16)23(19(15)27)10-12-4-6-13(20)7-5-12/h2-8,11,24-25H,9-10H2,1H3,(H,22,26)
InChIKeyFKVLKOGALOZOGM-UHFFFAOYSA-N
XLogP1.40
TPSA104.45 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.37
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

Gsk-364735
CID 54718859
7-[(4-fluorophenyl)methyl]-4-hydroxy-N,1-dimethyl-2-oxo-1,5-naphthyridine-3-carboxamide
CID 54729990
N-(2,2-difluoroethyl)-7-[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide
CID 58882896
7-[(4-fluorophenyl)methyl]-4-hydroxy-1-methyl-N-{2-[methyl(methylsulfonyl)amino]ethyl}-2-oxo-1,2-dihydro-1,5-naphthyridine-3-carboxamide
CID 69480972
7-[(4-fluorophenyl)methyl]-4-hydroxy-N-[(1S)-2-hydroxy-1-methylethyl]-1-methyl-2-oxo-1,2-dihydro-1,5-naphthyridine-3-carboxamide
CID 69481025
7-[(4-fluorophenyl)methyl]-4-hydroxy-N-(3-hydroxypropyl)-1-methyl-2-oxo-1,5-naphthyridine-3-carboxamide
CID 69482466
4-hydroxy-1-methyl-2-oxo-N-(pyridin-4-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54684726
N-[(4-fluorophenyl)methyl]-4-hydroxy-1-isopropyl-2-oxo-1,5-naphthyridine-3-carboxamide
CID 57395697
N-(4-fluorobenzyl)4-hydroxy-2-oxo-1,2-dihydro-1,5-naphthyridine-3-carboxamide
CID 54690727
N-Cyclopropyl-7-[(4-fluorophenyl)methyl]-4-hydroxy-2-oxo-1,2-dihydro-1,5-naphthyridine-3-carboxamide
CID 54690871
7-[(4-fluorophenyl)methyl]-4-hydroxy-N-(3-morpholin-4-ylpropyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide
CID 54697548
7-[(4-Fluorophenyl)methyl]-4-hydroxy-2-oxo-n-[3-(2-oxo-1-pyrrolidinyl)propyl]-1,2-dihydro-1,5-naphthyridine-3-carboxamide
CID 54698986

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide?
The IUPAC name of 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide (CID 142685092) is 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide is CC(O)CNC(=O)c1c(O)c2ncccc2n(Cc2ccc(F)cc2)c1=O.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide?
The InChIKey is FKVLKOGALOZOGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O4/c1-11(24)9-22-18(26)15-17(25)16-14(3-2-8-21-16)23(19(15)27)10-12-4-6-13(20)7-5-12/h2-8,11,24-25H,9-10H2,1H3,(H,22,26).
What are the key properties of 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide?
1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide has a molecular weight of 371.37 g/mol, XLogP of 1.40, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]-4-hydroxy-N-(2-hydroxypropyl)-2-oxo-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 142685092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).